input word = C00037913

Metabolite InformationStructural formula
Name threo-Anethole glycol
Anethole glycol
Formula C10H14O3
Mw 182.09429431
CAS RN 112018-74-3
C_ID C00037913 ,
InChIKey MRDZSBVJWOXBRW-NAJNNQRLNA-N
InChICode InChI=1S/C10H14O3/c1-7(11)10(12)8-3-5-9(13-2)6-4-8/h3-7,10-12H,1-2H3/t7-,10+/m0/s1
SMILES COc1ccc(cc1)[C@H](O)[C@@H](O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApiaceaePimpinella anisum Ref.
PlantaeApiaceaePimpinella anisum L. Ref.
PlantaeIlliciaceaeIllicium verum Ref.
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OrganismPimpinella anisum
ReferenceBalbiano, L. et al., JCS, 1907, 92, 522 (synth)